SCHEMBL8059997

SCHEMBL8059997

CCCCOc1ccc(C2SCCCS2)cc1OCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
PDE4A P27815 5/20 0.44
PDE4D Q08499 3/20 0.44
PDE4B Q07343 2/20 0.44
PDE4C Q08493 2/20 0.44
MAOA P21397 3/20 0.41
MAOB P27338 3/20 0.41
PPARG P37231 1/20 0.37
KMT2A Q03164 5/20 0.36
MAPT P10636 4/20 0.36
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
RAB9A P51151 1/20 0.36
MPO P05164 1/20 0.36
FDPS P14324 1/20 0.36
MEN1 O00255 3/20 0.35
MAPK1 P28482 2/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP1A2 P05177 2/20 0.35
TNF P01375 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3757194 0.94 TSHR (0.45) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL8057965 0.93 TSHR (0.53) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL8064807 0.93 TSHR (0.53) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL8058003 0.88 TSHR (0.51) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL9778817 0.86 TSHR (0.50) TSHRPDE4AMAOAMAOBKMT2A
SCHEMBL8059968 0.82 TSHR (0.47) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL12883744 0.81 MAOA (0.55) TSHRMAOAMAOBKMT2AMAPT
SCHEMBL9778782 0.79 TSHR (0.57) TSHRPDE4AKMT2AMAPTMEN1
SCHEMBL9778850 0.79 TSHR (0.57) TSHRPDE4APDE4DPDE4BPDE4C
SCHEMBL9778629 0.79 SIGMAR1 (0.41) TSHRPPARGMAPTNPC1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1004623-A1 Aryl thioacetals useful as stabilizers in polymeric materials GREAT LAKES CHEMICAL CORPORATION (US) 2000-05-31 EP disclosed